[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone

Systemtic Name: [4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone Openeye Name: [4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone CAS Name: [4-[(2-methyl-4-thiazolyl)methyl]-1,4-diazepan-1-yl]-(1-phenyl-5-propyl-4-pyrazolyl)methanone IUPAC Name: [4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]-(1-phenyl-5-propylpyrazol-4-yl)methanone Traditional Name: [4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]-(1-phenyl-5-propyl-pyrazol-4-yl)methanone Formula: C23H29N5OS MolecularWeight: 423.57426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN(CC3)CC4=CSC(=N4)C

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN(CC3)CC4=CSC(=N4)C

InChI

InChI=1S/C23H29N5OS/c1-3-8-22-21(15-24-28(22)20-9-5-4-6-10-20)23(29)27-12-7-11-26(13-14-27)16-19-17-30-18(2)25-19/h4-6,9-10,15,17H,3,7-8,11-14,16H2,1-2H3