N-[4-[(2,4-dichlorophenyl)methylamino]-2-[4-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]quinazolin-6-yl]cyclopropanecarboxamide

Systemtic Name: N-[4-[(2,4-dichlorophenyl)methylamino]-2-[4-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]quinazolin-6-yl]cyclopropanecarboxamide Openeye Name: N-[4-[(2,4-dichlorophenyl)methylamino]-2-[4-(2-pyrrolidin-1-ylethyl)-1-piperidyl]quinazolin-6-yl]cyclopropanecarboxamide CAS Name: N-[4-[(2,4-dichlorophenyl)methylamino]-2-[4-[2-(1-pyrrolidinyl)ethyl]-1-piperidinyl]-6-quinazolinyl]cyclopropanecarboxamide IUPAC Name: N-[4-[(2,4-dichlorophenyl)methylamino]-2-[4-(2-pyrrolidin-1-ylethyl)piperidin-1-yl]quinazolin-6-yl]cyclopropanecarboxamide Traditional Name: N-[4-[(2,4-dichlorobenzyl)amino]-2-[4-(2-pyrrolidinoethyl)piperidino]quinazolin-6-yl]cyclopropanecarboxamide Formula: C30H36Cl2N6O MolecularWeight: 567.55244

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC2CCN(CC2)C3=NC4=C(C=C(C=C4)NC(=O)C5CC5)C(=N3)NCC6=C(C=C(C=C6)Cl)Cl

Isomeric SMILES

C1CCN(C1)CCC2CCN(CC2)C3=NC4=C(C=C(C=C4)NC(=O)C5CC5)C(=N3)NCC6=C(C=C(C=C6)Cl)Cl

InChI

InChI=1S/C30H36Cl2N6O/c31-23-6-5-22(26(32)17-23)19-33-28-25-18-24(34-29(39)21-3-4-21)7-8-27(25)35-30(36-28)38-15-10-20(11-16-38)9-14-37-12-1-2-13-37/h5-8,17-18,20-21H,1-4,9-16,19H2,(H,34,39)(H,33,35,36)