(E)-N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(6-morpholino-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[6-(4-morpholinyl)-1,3-benzothiazol-2-yl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(6-morpholin-4-yl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(6-morpholino-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)acrylamide Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S/c25-19(7-4-14-2-1-3-16(12-14)24(26)27)22-20-21-17-6-5-15(13-18(17)29-20)23-8-10-28-11-9-23/h1-7,12-13H,8-11H2,(H,21,22,25)/b7-4+