1-(4-morpholin-4-ylsulfonylphenyl)-3-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]thiourea

Systemtic Name: 1-(4-morpholin-4-ylsulfonylphenyl)-3-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]thiourea Openeye Name: 1-(4-morpholinosulfonylphenyl)-3-[(E)-(2-phenylchroman-4-ylidene)amino]thiourea CAS Name: 1-[4-(4-morpholinylsulfonyl)phenyl]-3-[(E)-(2-phenyl-3,4-dihydro-2H-1-benzopyran-4-ylidene)amino]thiourea IUPAC Name: 1-(4-morpholin-4-ylsulfonylphenyl)-3-[(E)-(2-phenyl-2,3-dihydrochromen-4-ylidene)amino]thiourea Traditional Name: 1-(4-morpholinosulfonylphenyl)-3-[(E)-(2-phenylchroman-4-ylidene)amino]thiourea Formula: C26H26N4O4S2 MolecularWeight: 522.63904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NN=C3CC(OC4=CC=CC=C34)C5=CC=CC=C5

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=S)N/N=C/3\CC(OC4=CC=CC=C34)C5=CC=CC=C5

InChI

InChI=1S/C26H26N4O4S2/c31-36(32,30-14-16-33-17-15-30)21-12-10-20(11-13-21)27-26(35)29-28-23-18-25(19-6-2-1-3-7-19)34-24-9-5-4-8-22(23)24/h1-13,25H,14-18H2,(H2,27,29,35)/b28-23+