(E)-N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(5-methylthiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]-3-(5-methylthiophen-2-yl)prop-2-enamide Openeye Name: (E)-N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-(5-methyl-2-thienyl)prop-2-enamide CAS Name: (E)-N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-3-(5-methyl-2-thiophenyl)-2-propenamide IUPAC Name: (E)-N-[3-chloro-4-(3-oxopiperazin-1-yl)phenyl]-3-(5-methylthiophen-2-yl)prop-2-enamide Traditional Name: (E)-N-[3-chloro-4-(3-ketopiperazino)phenyl]-3-(5-methyl-2-thienyl)acrylamide Formula: C18H18ClN3O2S MolecularWeight: 375.87242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C=CC(=O)NC2=CC(=C(C=C2)N3CCNC(=O)C3)Cl

Isomeric SMILES

CC1=CC=C(S1)/C=C/C(=O)NC2=CC(=C(C=C2)N3CCNC(=O)C3)Cl

InChI

InChI=1S/C18H18ClN3O2S/c1-12-2-4-14(25-12)5-7-17(23)21-13-3-6-16(15(19)10-13)22-9-8-20-18(24)11-22/h2-7,10H,8-9,11H2,1H3,(H,20,24)(H,21,23)/b7-5+