N-(3-methylbutyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: N-(3-methylbutyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: N-isopentyl-N-[2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: N-(3-methylbutyl)-N-[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: N-(3-methylbutyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: N-isoamyl-N-[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]-3-(4-nitrophenyl)acrylamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CCC(C)C)C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N4O4S/c1-14(2)10-11-23(12-18(25)22-20-21-15(3)13-29-20)19(26)9-6-16-4-7-17(8-5-16)24(27)28/h4-9,13-14H,10-12H2,1-3H3,(H,21,22,25)