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

Systemtic Name: thiophen-3-yl N-cyclopropyl-N-[[3-(4-pyrrolidin-1-ylquinazolin-6-yl)phenyl]methyl]carbamate Openeye Name: 3-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 3-thiophenyl ester IUPAC Name: thiophen-3-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 3-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=CSC=C6

Isomeric SMILES

C1CCN(C1)C2=NC=NC3=C2C=C(C=C3)C4=CC(=CC=C4)CN(C5CC5)C(=O)OC6=CSC=C6

InChI

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