methyl 2-[1-[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]-3-oxidanylidene-piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-[(E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoyl]-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[1-[(E)-3-(3-chloro-1-benzothiophen-2-yl)-1-oxoprop-2-enyl]-3-oxo-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoyl]-3-oxopiperazin-2-yl]acetate Traditional Name: 2-[1-[(E)-3-(3-chlorobenzothiophen-2-yl)acryloyl]-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C18H17ClN2O4S MolecularWeight: 392.85658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCCN1C(=O)C=CC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

COC(=O)CC1C(=O)NCCN1C(=O)/C=C/C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C18H17ClN2O4S/c1-25-16(23)10-12-18(24)20-8-9-21(12)15(22)7-6-14-17(19)11-4-2-3-5-13(11)26-14/h2-7,12H,8-10H2,1H3,(H,20,24)/b7-6+