methyl 1-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]indole-3-carboxylate

Systemtic Name: methyl 1-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]indole-3-carboxylate Openeye Name: methyl 1-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-2-oxo-ethyl]indole-3-carboxylate CAS Name: 1-[2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-2-oxoethyl]-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-2-oxoethyl]indole-3-carboxylate Traditional Name: 1-[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-2-keto-ethyl]indole-3-carboxylic acid methyl ester Formula: C20H19ClN2O3S MolecularWeight: 402.89446

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N(CC=C)CC3=CC=C(S3)Cl

Isomeric SMILES

COC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N(CC=C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C20H19ClN2O3S/c1-3-10-22(11-14-8-9-18(21)27-14)19(24)13-23-12-16(20(25)26-2)15-6-4-5-7-17(15)23/h3-9,12H,1,10-11,13H2,2H3