S-[2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[(7-chloranyl-4-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[benzyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[benzyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[benzyl-(7-chloro-4-methoxy-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl] ester Formula: C19H17ClN2O3S2 MolecularWeight: 420.93288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)N(CC1=CC=CC=C1)C2=NC3=C(C=CC(=C3S2)Cl)OC

Isomeric SMILES

CC(=O)SCC(=O)N(CC1=CC=CC=C1)C2=NC3=C(C=CC(=C3S2)Cl)OC

InChI

InChI=1S/C19H17ClN2O3S2/c1-12(23)26-11-16(24)22(10-13-6-4-3-5-7-13)19-21-17-15(25-2)9-8-14(20)18(17)27-19/h3-9H,10-11H2,1-2H3