methyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-[(6-ethyl-1,3-benzothiazol-2-yl)amino]-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CN3C=C(C4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C21H19N3O3S/c1-3-13-8-9-16-18(10-13)28-21(22-16)23-19(25)12-24-11-15(20(26)27-2)14-6-4-5-7-17(14)24/h4-11H,3,12H2,1-2H3,(H,22,23,25)