N-[1-[5-(2-acetamido-1,3-thiazol-4-yl)-1-methyl-benzimidazol-2-yl]cyclobutyl]-3-cyclopentyl-1-methyl-2-pyrazin-2-yl-indole-6-carboxamide

Systemtic Name: N-[1-[5-(2-acetamido-1,3-thiazol-4-yl)-1-methyl-benzimidazol-2-yl]cyclobutyl]-3-cyclopentyl-1-methyl-2-pyrazin-2-yl-indole-6-carboxamide Openeye Name: N-[1-[5-(2-acetamidothiazol-4-yl)-1-methyl-benzimidazol-2-yl]cyclobutyl]-3-cyclopentyl-1-methyl-2-pyrazin-2-yl-indole-6-carboxamide CAS Name: N-[1-[5-(2-acetamido-4-thiazolyl)-1-methyl-2-benzimidazolyl]cyclobutyl]-3-cyclopentyl-1-methyl-2-(2-pyrazinyl)-6-indolecarboxamide IUPAC Name: N-[1-[5-(2-acetamido-1,3-thiazol-4-yl)-1-methylbenzimidazol-2-yl]cyclobutyl]-3-cyclopentyl-1-methyl-2-pyrazin-2-ylindole-6-carboxamide Traditional Name: N-[1-[5-(2-acetamidothiazol-4-yl)-1-methyl-benzimidazol-2-yl]cyclobutyl]-3-cyclopentyl-1-methyl-2-pyrazin-2-yl-indole-6-carboxamide Formula: C36H36N8O2S MolecularWeight: 644.78844

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)N(C(=N3)C4(CCC4)NC(=O)C5=CC6=C(C=C5)C(=C(N6C)C7=NC=CN=C7)C8CCCC8)C

Isomeric SMILES

CC(=O)NC1=NC(=CS1)C2=CC3=C(C=C2)N(C(=N3)C4(CCC4)NC(=O)C5=CC6=C(C=C5)C(=C(N6C)C7=NC=CN=C7)C8CCCC8)C

InChI

InChI=1S/C36H36N8O2S/c1-21(45)39-35-41-28(20-47-35)23-10-12-29-26(17-23)40-34(44(29)3)36(13-6-14-36)42-33(46)24-9-11-25-30(18-24)43(2)32(27-19-37-15-16-38-27)31(25)22-7-4-5-8-22/h9-12,15-20,22H,4-8,13-14H2,1-3H3,(H,42,46)(H,39,41,45)