2-[(E)-[(1-butylsulfonylindol-3-yl)-cyclopropyl-methylidene]amino]guanidine

Systemtic Name: 2-[(E)-[(1-butylsulfonylindol-3-yl)-cyclopropyl-methylidene]amino]guanidine Openeye Name: 2-[(E)-[(1-butylsulfonylindol-3-yl)-cyclopropyl-methylene]amino]guanidine CAS Name: 2-[(E)-[(1-butylsulfonyl-3-indolyl)-cyclopropylmethylidene]amino]guanidine IUPAC Name: 2-[(E)-[(1-butylsulfonylindol-3-yl)-cyclopropylmethylidene]amino]guanidine Traditional Name: 2-[(E)-[(1-butylsulfonylindol-3-yl)-cyclopropyl-methylene]amino]guanidine Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)N1C=C(C2=CC=CC=C21)C(=NN=C(N)N)C3CC3

Isomeric SMILES

CCCCS(=O)(=O)N1C=C(C2=CC=CC=C21)/C(=N/N=C(N)N)/C3CC3

InChI

InChI=1S/C17H23N5O2S/c1-2-3-10-25(23,24)22-11-14(13-6-4-5-7-15(13)22)16(12-8-9-12)20-21-17(18)19/h4-7,11-12H,2-3,8-10H2,1H3,(H4,18,19,21)/b20-16+