3H-1,3-benzothiazol-2-ylidene-[(4S)-4-[(4-chloranyl-2-methyl-phenyl)carbamoyl]-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl]azanium

Systemtic Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-4-[(4-chloranyl-2-methyl-phenyl)carbamoyl]-6-oxidanylidene-4,5-dihydro-1H-pyrimidin-2-yl]azanium Openeye Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-4-[(4-chloro-2-methyl-phenyl)carbamoyl]-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]ammonium CAS Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-4-[(4-chloro-2-methylanilino)-oxomethyl]-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]ammonium IUPAC Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-4-[(4-chloro-2-methylphenyl)carbamoyl]-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]azanium Traditional Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-4-[(4-chloro-2-methyl-phenyl)carbamoyl]-6-keto-4,5-dihydro-1H-pyrimidin-2-yl]ammonium Formula: C19H17ClN5O2S+ MolecularWeight: 414.88858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC(=O)C2CC(=O)NC(=N2)[NH+]=C3NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC(=O)[C@@H]2CC(=O)NC(=N2)[NH+]=C3NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16ClN5O2S/c1-10-8-11(20)6-7-12(10)21-17(27)14-9-16(26)24-18(22-14)25-19-23-13-4-2-3-5-15(13)28-19/h2-8,14H,9H2,1H3,(H,21,27)(H2,22,23,24,25,26)/p+1/t14-/m0/s1