4-bromanyl-N-[3-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-[allyl-[(5-chloro-2-thienyl)methyl]amino]-3-oxo-propyl]-4-bromo-benzamide CAS Name: 4-bromo-N-[3-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]-3-oxopropyl]benzamide IUPAC Name: 4-bromo-N-[3-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]-3-oxopropyl]benzamide Traditional Name: N-[3-[allyl-[(5-chloro-2-thienyl)methyl]amino]-3-keto-propyl]-4-bromo-benzamide Formula: C18H18BrClN2O2S MolecularWeight: 441.76972

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)C(=O)CCNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)C(=O)CCNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C18H18BrClN2O2S/c1-2-11-22(12-15-7-8-16(20)25-15)17(23)9-10-21-18(24)13-3-5-14(19)6-4-13/h2-8H,1,9-12H2,(H,21,24)