3-azanyl-1-oxidanylidene-N,N-bis(prop-2-ynyl)-5,6-dihydro-4H-benzo[f]quinazoline-8-sulfonamide

Systemtic Name: 3-azanyl-1-oxidanylidene-N,N-bis(prop-2-ynyl)-5,6-dihydro-4H-benzo[f]quinazoline-8-sulfonamide Openeye Name: 3-amino-1-oxo-N,N-bis(prop-2-ynyl)-5,6-dihydro-4H-benzo[f]quinazoline-8-sulfonamide CAS Name: 3-amino-1-oxo-N,N-bis(prop-2-ynyl)-5,6-dihydro-4H-benzo[f]quinazoline-8-sulfonamide IUPAC Name: 3-amino-1-oxo-N,N-bis(prop-2-ynyl)-5,6-dihydro-4H-benzo[f]quinazoline-8-sulfonamide Traditional Name: 3-amino-1-keto-N,N-dipropargyl-5,6-dihydro-4H-benzo[f]quinazoline-8-sulfonamide Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CC#C)S(=O)(=O)C1=CC2=C(C=C1)C3=C(CC2)NC(=NC3=O)N

Isomeric SMILES

C#CCN(CC#C)S(=O)(=O)C1=CC2=C(C=C1)C3=C(CC2)NC(=NC3=O)N

InChI

InChI=1S/C18H16N4O3S/c1-3-9-22(10-4-2)26(24,25)13-6-7-14-12(11-13)5-8-15-16(14)17(23)21-18(19)20-15/h1-2,6-7,11H,5,8-10H2,(H3,19,20,21,23)