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

Systemtic Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-6-oxidanylidene-4-(phenylcarbamoyl)-4,5-dihydro-1H-pyrimidin-2-yl]azanium Openeye Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-6-oxo-4-(phenylcarbamoyl)-4,5-dihydro-1H-pyrimidin-2-yl]ammonium CAS Name: [(4S)-4-[anilino(oxo)methyl]-6-oxo-4,5-dihydro-1H-pyrimidin-2-yl]-(3H-1,3-benzothiazol-2-ylidene)ammonium IUPAC Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-6-oxo-4-(phenylcarbamoyl)-4,5-dihydro-1H-pyrimidin-2-yl]azanium Traditional Name: 3H-1,3-benzothiazol-2-ylidene-[(4S)-6-keto-4-(phenylcarbamoyl)-4,5-dihydro-1H-pyrimidin-2-yl]ammonium Formula: C18H16N5O2S+ MolecularWeight: 366.41694

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(NC1=O)[NH+]=C2NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C1[C@H](N=C(NC1=O)[NH+]=C2NC3=CC=CC=C3S2)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C18H15N5O2S/c24-15-10-13(16(25)19-11-6-2-1-3-7-11)20-17(22-15)23-18-21-12-8-4-5-9-14(12)26-18/h1-9,13H,10H2,(H,19,25)(H2,20,21,22,23,24)/p+1/t13-/m0/s1