1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]-3-(2-phenylsulfanylethyl)thiourea

Systemtic Name: 1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)carbonylamino]-3-(2-phenylsulfanylethyl)thiourea Openeye Name: 1-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]-3-(2-phenylsulfanylethyl)thiourea CAS Name: 1-[[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-oxomethyl]amino]-3-[2-(phenylthio)ethyl]thiourea IUPAC Name: 1-[(5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)amino]-3-(2-phenylsulfanylethyl)thiourea Traditional Name: 1-[(5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)amino]-3-[2-(phenylthio)ethyl]thiourea Formula: C19H23N3OS3 MolecularWeight: 405.60042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCCSC3=CC=CC=C3

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NNC(=S)NCCSC3=CC=CC=C3

InChI

InChI=1S/C19H23N3OS3/c1-13-7-8-16-14(11-13)12-17(26-16)18(23)21-22-19(24)20-9-10-25-15-5-3-2-4-6-15/h2-6,12-13H,7-11H2,1H3,(H,21,23)(H2,20,22,24)