3-[[1-[3-azanyl-1-cyclopropyl-8-methyl-2,4-bis(oxidanylidene)quinazolin-7-yl]-3-methyl-pyrrolidin-3-yl]methylamino]propanenitrile

Systemtic Name: 3-[[1-[3-azanyl-1-cyclopropyl-8-methyl-2,4-bis(oxidanylidene)quinazolin-7-yl]-3-methyl-pyrrolidin-3-yl]methylamino]propanenitrile Openeye Name: 3-[[1-(3-amino-1-cyclopropyl-8-methyl-2,4-dioxo-quinazolin-7-yl)-3-methyl-pyrrolidin-3-yl]methylamino]propanenitrile CAS Name: 3-[[1-(3-amino-1-cyclopropyl-8-methyl-2,4-dioxo-7-quinazolinyl)-3-methyl-3-pyrrolidinyl]methylamino]propanenitrile IUPAC Name: 3-[[1-(3-amino-1-cyclopropyl-8-methyl-2,4-dioxoquinazolin-7-yl)-3-methylpyrrolidin-3-yl]methylamino]propanenitrile Traditional Name: 3-[[1-(3-amino-1-cyclopropyl-2,4-diketo-8-methyl-quinazolin-7-yl)-3-methyl-pyrrolidin-3-yl]methylamino]propionitrile Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=O)N(C2=O)N)C3CC3)N4CCC(C4)(C)CNCCC#N

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=O)N(C2=O)N)C3CC3)N4CCC(C4)(C)CNCCC#N

InChI

InChI=1S/C21H28N6O2/c1-14-17(25-11-8-21(2,13-25)12-24-10-3-9-22)7-6-16-18(14)26(15-4-5-15)20(29)27(23)19(16)28/h6-7,15,24H,3-5,8,10-13,23H2,1-2H3