2-[[4-(3-azanylpyrrolidin-1-yl)phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one

Systemtic Name: 2-[[4-(3-azanylpyrrolidin-1-yl)phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one Openeye Name: 2-[4-(3-aminopyrrolidin-1-yl)anilino]-8-isopropyl-1H-quinazolin-7-one CAS Name: 2-[4-(3-amino-1-pyrrolidinyl)anilino]-8-propan-2-yl-1H-quinazolin-7-one IUPAC Name: 2-[4-(3-aminopyrrolidin-1-yl)anilino]-8-propan-2-yl-1H-quinazolin-7-one Traditional Name: 2-[4-(3-aminopyrrolidino)anilino]-8-isopropyl-1H-quinazolin-7-one Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CN=C(N2)NC3=CC=C(C=C3)N4CCC(C4)N)C=CC1=O

Isomeric SMILES

CC(C)C1=C2C(=CN=C(N2)NC3=CC=C(C=C3)N4CCC(C4)N)C=CC1=O

InChI

InChI=1S/C21H25N5O/c1-13(2)19-18(27)8-3-14-11-23-21(25-20(14)19)24-16-4-6-17(7-5-16)26-10-9-15(22)12-26/h3-8,11,13,15H,9-10,12,22H2,1-2H3,(H2,23,24,25)