1-[[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]amino]-3-(2-methylphenyl)thiourea

Systemtic Name: 1-[[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]amino]-3-(2-methylphenyl)thiourea Openeye Name: 1-[[(E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoyl]amino]-3-(o-tolyl)thiourea CAS Name: 1-[[(E)-3-(3-chloro-1-benzothiophen-2-yl)-1-oxoprop-2-enyl]amino]-3-(2-methylphenyl)thiourea IUPAC Name: 1-[[(E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoyl]amino]-3-(2-methylphenyl)thiourea Traditional Name: 1-[[(E)-3-(3-chlorobenzothiophen-2-yl)acryloyl]amino]-3-(o-tolyl)thiourea Formula: C19H16ClN3OS2 MolecularWeight: 401.93284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)C=CC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)/C=C/C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C19H16ClN3OS2/c1-12-6-2-4-8-14(12)21-19(25)23-22-17(24)11-10-16-18(20)13-7-3-5-9-15(13)26-16/h2-11H,1H3,(H,22,24)(H2,21,23,25)/b11-10+