4-(azepan-4-yl)-N-(1-nonylpyrrolidin-3-yl)-5,6,7,8-tetrahydroquinazolin-2-amine

Systemtic Name: 4-(azepan-4-yl)-N-(1-nonylpyrrolidin-3-yl)-5,6,7,8-tetrahydroquinazolin-2-amine Openeye Name: 4-(azepan-4-yl)-N-(1-nonylpyrrolidin-3-yl)-5,6,7,8-tetrahydroquinazolin-2-amine CAS Name: 4-(4-azepanyl)-N-(1-nonyl-3-pyrrolidinyl)-5,6,7,8-tetrahydroquinazolin-2-amine IUPAC Name: 4-(azepan-4-yl)-N-(1-nonylpyrrolidin-3-yl)-5,6,7,8-tetrahydroquinazolin-2-amine Traditional Name: [4-(azepan-4-yl)-5,6,7,8-tetrahydroquinazolin-2-yl]-(1-nonylpyrrolidin-3-yl)amine Formula: C27H47N5 MolecularWeight: 441.69558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1CCC(C1)NC2=NC3=C(CCCC3)C(=N2)C4CCCNCC4

Isomeric SMILES

CCCCCCCCCN1CCC(C1)NC2=NC3=C(CCCC3)C(=N2)C4CCCNCC4

InChI

InChI=1S/C27H47N5/c1-2-3-4-5-6-7-10-19-32-20-16-23(21-32)29-27-30-25-14-9-8-13-24(25)26(31-27)22-12-11-17-28-18-15-22/h22-23,28H,2-21H2,1H3,(H,29,30,31)