N-(3-propan-2-yloxypropyl)-6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide

Systemtic Name: N-(3-propan-2-yloxypropyl)-6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide Openeye Name: N-(3-isopropoxypropyl)-6-thioxo-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide CAS Name: N-(3-propan-2-yloxypropyl)-6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide IUPAC Name: N-(3-propan-2-yloxypropyl)-6-sulfanylidene-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide Traditional Name: N-(3-isopropoxypropyl)-6-thioxo-5H-benzimidazolo[1,2-c]quinazoline-3-carboxamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=S)N2

Isomeric SMILES

CC(C)OCCCNC(=O)C1=CC2=C(C=C1)C3=NC4=CC=CC=C4N3C(=S)N2

InChI

InChI=1S/C21H22N4O2S/c1-13(2)27-11-5-10-22-20(26)14-8-9-15-17(12-14)24-21(28)25-18-7-4-3-6-16(18)23-19(15)25/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H,22,26)(H,24,28)