thiophen-2-yl N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]carbamate

Systemtic Name: thiophen-2-yl N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]carbamate Openeye Name: 2-thienyl N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]carbamate CAS Name: N-cyclopropyl-N-[[3-[4-(1-pyrrolidinyl)-6-quinazolinyl]phenyl]methyl]carbamic acid thiophen-2-yl ester IUPAC Name: thiophen-2-yl N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]carbamate Traditional Name: N-cyclopropyl-N-[3-(4-pyrrolidinoquinazolin-6-yl)benzyl]carbamic acid 2-thienyl ester Formula: C27H26N4O2S MolecularWeight: 470.58594

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)OC6=CC=CS6

Isomeric SMILES

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)OC6=CC=CS6

InChI

InChI=1S/C27H26N4O2S/c32-27(33-25-7-4-14-34-25)31(22-9-10-22)17-19-5-3-6-20(15-19)21-8-11-24-23(16-21)26(29-18-28-24)30-12-1-2-13-30/h3-8,11,14-16,18,22H,1-2,9-10,12-13,17H2