3-ethoxy-N-methylsulfanyl-N-(phenylmethyl)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-1-carboxamide

Systemtic Name: 3-ethoxy-N-methylsulfanyl-N-(phenylmethyl)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-1-carboxamide Openeye Name: N-benzyl-3-ethoxy-N-methylsulfanyl-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-1-carboxamide CAS Name: 3-ethoxy-N-(methylthio)-N-(phenylmethyl)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-1-carboxamide IUPAC Name: N-benzyl-3-ethoxy-N-methylsulfanyl-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-1-carboxamide Traditional Name: N-benzyl-3-ethoxy-N-(methylthio)-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazoline-1-carboxamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1CC(N2C1=NC3=CC=CC=C3C2)C(=O)N(CC4=CC=CC=C4)SC

Isomeric SMILES

CCOC1CC(N2C1=NC3=CC=CC=C3C2)C(=O)N(CC4=CC=CC=C4)SC

InChI

InChI=1S/C22H25N3O2S/c1-3-27-20-13-19(22(26)25(28-2)14-16-9-5-4-6-10-16)24-15-17-11-7-8-12-18(17)23-21(20)24/h4-12,19-20H,3,13-15H2,1-2H3