[5-[2-[[2-[bis(azanyl)methylideneamino]-1,3-thiazol-5-yl]methylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-11H-benzo[c][1]benzazepin-11-yl] ethanoate

Systemtic Name: [5-[2-[[2-[bis(azanyl)methylideneamino]-1,3-thiazol-5-yl]methylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-11H-benzo[c][1]benzazepin-11-yl] ethanoate Openeye Name: [5-[2-[(2-guanidinothiazol-5-yl)methylamino]-2-oxo-ethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl] acetate CAS Name: acetic acid [5-[2-[[2-(diaminomethylideneamino)-5-thiazolyl]methylamino]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl] ester IUPAC Name: [5-[2-[[2-(diaminomethylideneamino)-1,3-thiazol-5-yl]methylamino]-2-oxoethyl]-6-oxo-11H-benzo[c][1]benzazepin-11-yl] acetate Traditional Name: acetic acid [5-[2-[(2-guanidinothiazol-5-yl)methylamino]-2-keto-ethyl]-6-keto-11H-benzo[c][1]benzazepin-11-yl] ester Formula: C23H22N6O4S MolecularWeight: 478.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2=CC=CC=C2C(=O)N(C3=CC=CC=C13)CC(=O)NCC4=CN=C(S4)N=C(N)N

Isomeric SMILES

CC(=O)OC1C2=CC=CC=C2C(=O)N(C3=CC=CC=C13)CC(=O)NCC4=CN=C(S4)N=C(N)N

InChI

InChI=1S/C23H22N6O4S/c1-13(30)33-20-15-6-2-3-7-16(15)21(32)29(18-9-5-4-8-17(18)20)12-19(31)26-10-14-11-27-23(34-14)28-22(24)25/h2-9,11,20H,10,12H2,1H3,(H,26,31)(H4,24,25,27,28)