[4-azanyl-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazol-5-yl]-(azepan-1-yl)methanone

Systemtic Name: [4-azanyl-3-(phenylmethyl)-2-sulfanylidene-1,3-thiazol-5-yl]-(azepan-1-yl)methanone Openeye Name: (4-amino-3-benzyl-2-thioxo-thiazol-5-yl)-(azepan-1-yl)methanone CAS Name: [4-amino-3-(phenylmethyl)-2-sulfanylidene-5-thiazolyl]-(1-azepanyl)methanone IUPAC Name: (4-amino-3-benzyl-2-sulfanylidene-1,3-thiazol-5-yl)-(azepan-1-yl)methanone Traditional Name: (4-amino-3-benzyl-2-thioxo-4-thiazolin-5-yl)-(azepan-1-yl)methanone Formula: C17H21N3OS2 MolecularWeight: 347.49814

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=C(N(C(=S)S2)CC3=CC=CC=C3)N

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=C(N(C(=S)S2)CC3=CC=CC=C3)N

InChI

InChI=1S/C17H21N3OS2/c18-15-14(16(21)19-10-6-1-2-7-11-19)23-17(22)20(15)12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12,18H2