N-[3-[[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide

Systemtic Name: N-[3-[[3-chloranyl-4-(3-oxidanylidenepiperazin-1-yl)phenyl]amino]-3-oxidanylidene-propyl]thiophene-3-carboxamide Openeye Name: N-[3-[3-chloro-4-(3-oxopiperazin-1-yl)anilino]-3-oxo-propyl]thiophene-3-carboxamide CAS Name: N-[3-[3-chloro-4-(3-oxo-1-piperazinyl)anilino]-3-oxopropyl]-3-thiophenecarboxamide IUPAC Name: N-[3-[3-chloro-4-(3-oxopiperazin-1-yl)anilino]-3-oxopropyl]thiophene-3-carboxamide Traditional Name: N-[3-[3-chloro-4-(3-ketopiperazino)anilino]-3-keto-propyl]thiophene-3-carboxamide Formula: C18H19ClN4O3S MolecularWeight: 406.88646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)NC(=O)CCNC(=O)C3=CSC=C3)Cl

InChI

InChI=1S/C18H19ClN4O3S/c19-14-9-13(1-2-15(14)23-7-6-20-17(25)10-23)22-16(24)3-5-21-18(26)12-4-8-27-11-12/h1-2,4,8-9,11H,3,5-7,10H2,(H,20,25)(H,21,26)(H,22,24)