[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(5-chloranylthiophen-2-yl)methyl]-prop-2-enyl-azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-[(5-chloranylthiophen-2-yl)methyl]-prop-2-enyl-azanium Openeye Name: allyl-[[3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl]-[(5-chloro-2-thienyl)methyl]ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-[(5-chloro-2-thiophenyl)methyl]-prop-2-enylammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-[(5-chlorothiophen-2-yl)methyl]-prop-2-enylazanium Traditional Name: allyl-[[3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl]-[(5-chloro-2-thienyl)methyl]ammonium Formula: C19H20ClN4O2S+ MolecularWeight: 403.9057

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+](CC1=CC=C(S1)Cl)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

C=CC[NH+](CC1=CC=C(S1)Cl)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C19H19ClN4O2S/c1-2-9-23(10-13-7-8-16(20)27-13)12-18-22-15-6-4-3-5-14(15)19(26)24(18)11-17(21)25/h2-8H,1,9-12H2,(H2,21,25)/p+1