[(E)-(6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] 4-chloranylbenzoate

Systemtic Name: [(E)-(6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] 4-chloranylbenzoate Openeye Name: [(E)-(6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(E)-[6,6-dimethyl-3-(methylthio)-5,7-dihydro-2-benzothiophen-4-ylidene]amino] ester IUPAC Name: [(E)-(6,6-dimethyl-3-methylsulfanyl-5,7-dihydro-2-benzothiophen-4-ylidene)amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(E)-[6,6-dimethyl-3-(methylthio)-5,7-dihydroisobenzothiophen-4-ylidene]amino] ester Formula: C18H18ClNO2S2 MolecularWeight: 379.92402

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CSC(=C2C(=NOC(=O)C3=CC=C(C=C3)Cl)C1)SC)C

Isomeric SMILES

CC1(CC2=CSC(=C2/C(=N/OC(=O)C3=CC=C(C=C3)Cl)/C1)SC)C

InChI

InChI=1S/C18H18ClNO2S2/c1-18(2)8-12-10-24-17(23-3)15(12)14(9-18)20-22-16(21)11-4-6-13(19)7-5-11/h4-7,10H,8-9H2,1-3H3/b20-14+