2-(1,3-benzothiazol-6-ylamino)-6-[2-dimethylaminoethyl-(phenylmethyl)amino]-1H-1,3,5-triazin-4-one

Systemtic Name: 2-(1,3-benzothiazol-6-ylamino)-6-[2-dimethylaminoethyl-(phenylmethyl)amino]-1H-1,3,5-triazin-4-one Openeye Name: 2-(1,3-benzothiazol-6-ylamino)-6-[benzyl(2-dimethylaminoethyl)amino]-1H-1,3,5-triazin-4-one CAS Name: 2-(1,3-benzothiazol-6-ylamino)-6-[2-dimethylaminoethyl-(phenylmethyl)amino]-1H-1,3,5-triazin-4-one IUPAC Name: 2-(1,3-benzothiazol-6-ylamino)-6-[benzyl(2-dimethylaminoethyl)amino]-1H-1,3,5-triazin-4-one Traditional Name: 2-(1,3-benzothiazol-6-ylamino)-6-[benzyl(2-dimethylaminoethyl)amino]-1H-s-triazin-4-one Formula: C21H23N7OS MolecularWeight: 421.51862

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN(CC1=CC=CC=C1)C2=NC(=O)N=C(N2)NC3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CN(C)CCN(CC1=CC=CC=C1)C2=NC(=O)N=C(N2)NC3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C21H23N7OS/c1-27(2)10-11-28(13-15-6-4-3-5-7-15)20-24-19(25-21(29)26-20)23-16-8-9-17-18(12-16)30-14-22-17/h3-9,12,14H,10-11,13H2,1-2H3,(H2,23,24,25,26,29)