methyl 2-[1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxidanylidene-propyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[3-[(3-cyano-2-thienyl)amino]-3-oxo-propyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[3-[(3-cyano-2-thiophenyl)amino]-3-oxopropyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[3-[(3-cyanothiophen-2-yl)amino]-3-oxopropyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[3-[(3-cyano-2-thienyl)amino]-3-keto-propyl]-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1CCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1CCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C15H18N4O4S/c1-23-13(21)8-11-14(22)17-4-6-19(11)5-2-12(20)18-15-10(9-16)3-7-24-15/h3,7,11H,2,4-6,8H2,1H3,(H,17,22)(H,18,20)