methyl 3-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[allyl-[(5-chloro-2-thienyl)methyl]amino]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C16H17ClN2O3S2 MolecularWeight: 384.90078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CN(CC=C)CC2=CC=C(S2)Cl

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CN(CC=C)CC2=CC=C(S2)Cl

InChI

InChI=1S/C16H17ClN2O3S2/c1-3-7-19(9-11-4-5-13(17)24-11)10-14(20)18-12-6-8-23-15(12)16(21)22-2/h3-6,8H,1,7,9-10H2,2H3,(H,18,20)