2-[[4-[4-(2-azanylethanoyl)piperazin-1-yl]phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one

Systemtic Name: 2-[[4-[4-(2-azanylethanoyl)piperazin-1-yl]phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one Openeye Name: 2-[4-[4-(2-aminoacetyl)piperazin-1-yl]anilino]-8-isopropyl-1H-quinazolin-7-one CAS Name: 2-[4-[4-(2-amino-1-oxoethyl)-1-piperazinyl]anilino]-8-propan-2-yl-1H-quinazolin-7-one IUPAC Name: 2-[4-[4-(2-aminoacetyl)piperazin-1-yl]anilino]-8-propan-2-yl-1H-quinazolin-7-one Traditional Name: 2-[4-(4-glycylpiperazino)anilino]-8-isopropyl-1H-quinazolin-7-one Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CN=C(N2)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)CN)C=CC1=O

Isomeric SMILES

CC(C)C1=C2C(=CN=C(N2)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)CN)C=CC1=O

InChI

InChI=1S/C23H28N6O2/c1-15(2)21-19(30)8-3-16-14-25-23(27-22(16)21)26-17-4-6-18(7-5-17)28-9-11-29(12-10-28)20(31)13-24/h3-8,14-15H,9-13,24H2,1-2H3,(H2,25,26,27)