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

Systemtic Name: (5-methylsulfanylthiophen-2-yl)-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (5-methylsulfanyl-2-thienyl)-[4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone CAS Name: [4-[(2-methyl-4-thiazolyl)methyl]-1,4-diazepan-1-yl]-[5-(methylthio)-2-thiophenyl]methanone IUPAC Name: (5-methylsulfanylthiophen-2-yl)-[4-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: [4-[(2-methylthiazol-4-yl)methyl]-1,4-diazepan-1-yl]-[5-(methylthio)-2-thienyl]methanone Formula: C16H21N3OS3 MolecularWeight: 367.55244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)C3=CC=C(S3)SC

Isomeric SMILES

CC1=NC(=CS1)CN2CCCN(CC2)C(=O)C3=CC=C(S3)SC

InChI

InChI=1S/C16H21N3OS3/c1-12-17-13(11-22-12)10-18-6-3-7-19(9-8-18)16(20)14-4-5-15(21-2)23-14/h4-5,11H,3,6-10H2,1-2H3