2-[[4-[4-(2-azanyl-3-methyl-butanoyl)piperazin-1-yl]phenyl]amino]-8-cyclopentyl-5,6-dihydro-1H-quinazolin-7-one

Systemtic Name: 2-[[4-[4-(2-azanyl-3-methyl-butanoyl)piperazin-1-yl]phenyl]amino]-8-cyclopentyl-5,6-dihydro-1H-quinazolin-7-one Openeye Name: 2-[4-[4-(2-amino-3-methyl-butanoyl)piperazin-1-yl]anilino]-8-cyclopentyl-5,6-dihydro-1H-quinazolin-7-one CAS Name: 2-[4-[4-(2-amino-3-methyl-1-oxobutyl)-1-piperazinyl]anilino]-8-cyclopentyl-5,6-dihydro-1H-quinazolin-7-one IUPAC Name: 2-[4-[4-(2-amino-3-methylbutanoyl)piperazin-1-yl]anilino]-8-cyclopentyl-5,6-dihydro-1H-quinazolin-7-one Traditional Name: 2-[4-[4-(2-amino-3-methyl-butanoyl)piperazino]anilino]-8-cyclopentyl-5,6-dihydro-1H-quinazolin-7-one Formula: C28H38N6O2 MolecularWeight: 490.64032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4CCC(=O)C(=C4N3)C5CCCC5)N

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4CCC(=O)C(=C4N3)C5CCCC5)N

InChI

InChI=1S/C28H38N6O2/c1-18(2)25(29)27(36)34-15-13-33(14-16-34)22-10-8-21(9-11-22)31-28-30-17-20-7-12-23(35)24(26(20)32-28)19-5-3-4-6-19/h8-11,17-19,25H,3-7,12-16,29H2,1-2H3,(H2,30,31,32)