(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-[4-methyl-2-(3-thienyl)thiazol-5-yl]methanone CAS Name: [4-methyl-2-(3-thiophenyl)-5-thiazolyl]-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(4-methyl-2-thiophen-3-yl-1,3-thiazol-5-yl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-[4-methyl-2-(3-thienyl)thiazol-5-yl]methanone Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CSC=C2)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=N1)C2=CSC=C2)C(=O)N3CCCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H23N3OS2/c1-16-19(27-20(22-16)18-8-13-26-15-18)21(25)24-10-5-9-23(11-12-24)14-17-6-3-2-4-7-17/h2-4,6-8,13,15H,5,9-12,14H2,1H3