2-[[(2-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-phenethyl-N-(phenylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(2-fluorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-phenethyl-N-(phenylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-benzyl-2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-phenethyl-thiazole-4-carboxamide CAS Name: 2-[[[(2-fluoroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-phenethyl-N-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzyl-2-[[(2-fluorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-phenethyl-1,3-thiazole-4-carboxamide Traditional Name: N-benzyl-2-[[(2-fluorophenyl)carbamoyl-isopropyl-amino]methyl]-N-phenethyl-thiazole-4-carboxamide Formula: C30H31FN4O2S MolecularWeight: 530.656143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4F

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C30H31FN4O2S/c1-22(2)35(30(37)33-26-16-10-9-15-25(26)31)20-28-32-27(21-38-28)29(36)34(19-24-13-7-4-8-14-24)18-17-23-11-5-3-6-12-23/h3-16,21-22H,17-20H2,1-2H3,(H,33,37)