(E)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)-2-[4-(4-methoxyphenyl)piperazin-1-yl]carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]prop-2-enenitrile CAS Name: (E)-3-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)-2-[[4-(4-methoxyphenyl)-1-piperazinyl]-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]prop-2-enenitrile Traditional Name: (E)-3-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)-2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]acrylonitrile Formula: C24H30N4O2 MolecularWeight: 406.5206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C=C(C#N)C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)/C=C(\C#N)/C(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H30N4O2/c1-17(2)28-18(3)14-20(19(28)4)15-21(16-25)24(29)27-12-10-26(11-13-27)22-6-8-23(30-5)9-7-22/h6-9,14-15,17H,10-13H2,1-5H3/b21-15+